ChemSpider 2D Image | Dimethyl [(R)-[(R)-(4-methylphenyl)sulfinyl](methylsulfanyl)methyl]phosphonate | C11H17O4PS2

Dimethyl [(R)-[(R)-(4-methylphenyl)sulfinyl](methylsulfanyl)methyl]phosphonate

  • Molecular FormulaC11H17O4PS2
  • Average mass308.354 Da
  • Monoisotopic mass308.030579 Da
  • ChemSpider ID74052043

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[(R)-[(R)-(4-Méthylphényl)sulfinyl](méthylsulfanyl)méthyl]phosphonate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl [(R)-[(R)-(4-methylphenyl)sulfinyl](methylsulfanyl)methyl]phosphonate [ACD/IUPAC Name]
Dimethyl-[(R)-[(R)-(4-methylphenyl)sulfinyl](methylsulfanyl)methyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[(R)-[(R)-(4-methylphenyl)sulfinyl](methylthio)methyl]-, dimethyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 438.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 218.7±28.7 °C
Index of Refraction: 1.568
Molar Refractivity: 77.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.13
ACD/KOC (pH 5.5): 155.91
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.13
ACD/KOC (pH 7.4): 155.91
Polar Surface Area: 107 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 53.9±5.0 dyne/cm
Molar Volume: 235.3±5.0 cm3

Click to predict properties on the Chemicalize site


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